Base information
| Cat. No. | |
| CAS No. | 20357-30-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6BrNO4 |
| Molecular Weight | 272.052 |
| Exact Mass | 270.948 |
| XLogP3 | 2.9783 |
| Mr | 59.6338 |
| PSA | 83.12 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C=Cc1ccc(cc1[N+](=O)[O-])Br |
